4-(4-chlorophenyl)-3-[(1-methoxy-3,3-dimethyl-1-oxidanylidene-butan-2-yl)carbamoyl]hexanoic acid

Systemtic Name: 4-(4-chlorophenyl)-3-[(1-methoxy-3,3-dimethyl-1-oxidanylidene-butan-2-yl)carbamoyl]hexanoic acid Openeye Name: 4-(4-chlorophenyl)-3-[(1-methoxycarbonyl-2,2-dimethyl-propyl)carbamoyl]hexanoic acid CAS Name: 4-(4-chlorophenyl)-3-[[(1-methoxy-3,3-dimethyl-1-oxobutan-2-yl)amino]-oxomethyl]hexanoic acid IUPAC Name: 4-(4-chlorophenyl)-3-[(1-methoxy-3,3-dimethyl-1-oxobutan-2-yl)carbamoyl]hexanoic acid Traditional Name: 3-[(1-carbomethoxy-2,2-dimethyl-propyl)carbamoyl]-4-(4-chlorophenyl)hexanoic acid Formula: C20H28ClNO5 MolecularWeight: 397.89302

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Cl)C(CC(=O)O)C(=O)NC(C(=O)OC)C(C)(C)C

Isomeric SMILES

CCC(C1=CC=C(C=C1)Cl)C(CC(=O)O)C(=O)NC(C(=O)OC)C(C)(C)C

InChI

InChI=1S/C20H28ClNO5/c1-6-14(12-7-9-13(21)10-8-12)15(11-16(23)24)18(25)22-17(19(26)27-5)20(2,3)4/h7-10,14-15,17H,6,11H2,1-5H3,(H,22,25)(H,23,24)